1-(4,6-dimethylpyrimidin-2-yl)-3-[(4-ethylphenyl)amino]-6,6-dimethyl-5,7-dihydroindazol-4-one

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-[(4-ethylphenyl)amino]-6,6-dimethyl-5,7-dihydroindazol-4-one Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(4-ethylanilino)-6,6-dimethyl-5,7-dihydroindazol-4-one CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-3-(4-ethylanilino)-6,6-dimethyl-5,7-dihydroindazol-4-one IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(4-ethylanilino)-6,6-dimethyl-5,7-dihydroindazol-4-one Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(4-ethylanilino)-6,6-dimethyl-5,7-dihydroindazol-4-one Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NN(C3=C2C(=O)CC(C3)(C)C)C4=NC(=CC(=N4)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NN(C3=C2C(=O)CC(C3)(C)C)C4=NC(=CC(=N4)C)C

InChI

InChI=1S/C23H27N5O/c1-6-16-7-9-17(10-8-16)26-21-20-18(12-23(4,5)13-19(20)29)28(27-21)22-24-14(2)11-15(3)25-22/h7-11H,6,12-13H2,1-5H3,(H,26,27)